SCHEMBL8002556

SCHEMBL8002556

CCC(CCC[C]=O)C(N)=O

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CA2 P00918 6/20 0.64
CA1 P00915 4/20 0.64
MAPK1 P28482 1/20 0.41
SLC1A2 P43004 3/20 0.32
SLC1A1 P43005 3/20 0.32
SLC1A3 P43003 2/20 0.32
GRIK1 P39086 2/20 0.31
GRIK2 Q13002 2/20 0.31
USP2 O75604 1/20 0.30
TSHR P16473 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8011714 0.88 CA2 (0.57) CA2CA1MAPK1SLC1A2SLC1A1
SCHEMBL7038841 0.79 CA2 (1.00) CA2CA1MAPK1SLC1A2SLC1A1
SCHEMBL376915 0.79 CA2 (1.00) CA2CA1MAPK1SLC1A2SLC1A1
SCHEMBL7852802 0.77 CA2 (0.72) CA2CA1MAPK1
SCHEMBL312184 0.77 CA2 (0.72) CA2CA1MAPK1SLC1A2SLC1A1
SCHEMBL5446281 0.77 CA2 (0.72) CA2CA1MAPK1SLC1A2SLC1A1
SCHEMBL9542331 0.77 CA2 (0.95) CA2CA1MAPK1SLC1A2SLC1A1
SCHEMBL277393 0.77 CA2 (0.87) CA2CA1MAPK1SLC1A2SLC1A1
SCHEMBL1537431 0.77 CA2 (0.95) CA2CA1MAPK1SLC1A2SLC1A1
SCHEMBL6445932 0.77 CA2 (0.95) CA2CA1MAPK1SLC1A2SLC1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6117822-A AS HERBICIDES AND PLANT DESICCANTS AND/OR DEFOLIANTS BASF AKTIENGESELLSCHAFT (DE) 2000-09-12 US disclosed
EP-0788479-B1 SUBSTITUTED PHTHALIMIDO-CINNAMIC ACID DERIVATIVES WITH HERBICIDAL EFFECT BASF AG (DE) 2000-04-19 EP disclosed
EP-0939078-A2 Substituted phthalimido-cinnamic acid derivatives with herbicidal activity BASF AKTIENGESELLSCHAFT (DE) 1999-09-01 EP disclosed
US-5807807-A HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1998-09-15 US disclosed
US-5707937-A AGRICULTURAL HERBICIDES, DESICCANTS, DEFOLIANTS, HARVESTING AIDS BASF AKTIENGESELLSCHAFT (DE) 1998-01-13 US disclosed
WO-1996014298-A1 SUBSTITUTED PHTHALIMIDO-CINNAMIC ACID DERIVATIVES WITH HERBICIDAL EFFECT BASF AKTIENGESELLSCHAFT (DE) 1996-05-17 WO disclosed